1-butyl-3-[2-(3-chlorophenyl)ethyl]thiourea

Systemtic Name: 1-butyl-3-[2-(3-chlorophenyl)ethyl]thiourea Openeye Name: 1-butyl-3-[2-(3-chlorophenyl)ethyl]thiourea CAS Name: 1-butyl-3-[2-(3-chlorophenyl)ethyl]thiourea IUPAC Name: 1-butyl-3-[2-(3-chlorophenyl)ethyl]thiourea Traditional Name: 1-butyl-3-[2-(3-chlorophenyl)ethyl]thiourea Formula: C13H19ClN2S MolecularWeight: 270.82136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NCCC1=CC(=CC=C1)Cl

Isomeric SMILES

CCCCNC(=S)NCCC1=CC(=CC=C1)Cl

InChI

InChI=1S/C13H19ClN2S/c1-2-3-8-15-13(17)16-9-7-11-5-4-6-12(14)10-11/h4-6,10H,2-3,7-9H2,1H3,(H2,15,16,17)